REMARK  Name = BDB027696
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.465   1.061  -0.061  0.00  0.00    +0.135 A 
ATOM      2  C   LIG    1        0.009   2.369   0.176  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1       -1.372   2.501   0.323  0.00  0.00    +0.095 A 
ATOM      4  C   LIG    1       -1.840   3.786   0.551  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1       -1.080   4.909   0.650  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1        0.247   4.745   0.521  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1       -2.219   1.463   0.253  0.00  0.00    -0.226 NA
ATOM      8  C   LIG    1       -1.689   0.250   0.038  0.00  0.00    +0.162 A 
ATOM      9  C   LIG    1        0.834   3.515   0.287  0.00  0.00    +0.033 A 
ATOM     10  N   LIG    1       -0.378   0.015  -0.121  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1       -2.604  -0.903  -0.033  0.00  0.00    +0.022 A 
ATOM     12  C   LIG    1       -3.984  -0.762   0.178  0.00  0.00    +0.031 A 
ATOM     13  C   LIG    1       -4.804  -1.877   0.100  0.00  0.00    +0.111 A 
ATOM     14  N   LIG    1       -4.357  -3.119  -0.171  0.00  0.00    -0.263 NA
ATOM     15  C   LIG    1       -3.032  -3.251  -0.374  0.00  0.00    +0.111 A 
ATOM     16  C   LIG    1       -2.135  -2.196  -0.317  0.00  0.00    +0.031 A 
ENDBRANCH   8  11
BRANCH   1  17
ATOM     17  N   LIG    1        1.855   0.843  -0.264  0.00  0.00    -0.299 N 
ATOM     18  H   LIG    1        2.171   1.435  -1.026  0.00  0.00    +0.154 HD
BRANCH  17  23
ATOM     19  F   LIG    1        4.791  -3.870  -0.088  0.00  0.00    -0.205 F 
ATOM     20  C   LIG    1        4.070  -2.742  -0.133  0.00  0.00    +0.124 A 
ATOM     21  C   LIG    1        4.499  -1.686  -0.925  0.00  0.00    +0.040 A 
ATOM     22  C   LIG    1        3.748  -0.508  -0.968  0.00  0.00    +0.026 A 
ATOM     23  C   LIG    1        2.551  -0.387  -0.241  0.00  0.00    +0.033 A 
ATOM     24  C   LIG    1        2.163  -1.458   0.578  0.00  0.00    +0.026 A 
ATOM     25  C   LIG    1        2.912  -2.637   0.624  0.00  0.00    +0.040 A 
ENDBRANCH  17  23
ENDBRANCH   1  17
TORSDOF 3